==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CATALYTIC ANTIBODY 18-MAR-98 15C8 . COMPND 2 MOLECULE: IGG 5C8 FAB (LIGHT CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR K.GRUBER,I.A.WILSON . 430 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19502.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 274 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 172 40.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 41 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 2 6 4 3 8 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 4 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 L D 0 0 132 0, 0.0 2,-0.6 0, 0.0 94,-0.1 0.000 360.0 360.0 360.0 111.5 55.8 23.0 30.5 2 2 L I - 0 0 1 92,-0.5 2,-0.5 94,-0.4 89,-0.1 -0.737 360.0-143.5 -80.8 120.7 56.0 25.7 33.1 3 3 L V - 0 0 78 -2,-0.6 23,-1.7 95,-0.1 2,-0.5 -0.767 8.8-155.4 -90.1 130.7 58.7 24.5 35.5 4 4 L L E -A 25 0A 10 -2,-0.5 2,-0.5 95,-0.4 97,-0.4 -0.908 7.2-166.3-105.1 126.3 58.2 25.3 39.2 5 5 L T E -A 24 0A 80 19,-2.8 19,-2.6 -2,-0.5 2,-0.4 -0.959 3.0-161.7-115.3 125.3 61.3 25.5 41.4 6 6 L Q E -A 23 0A 17 -2,-0.5 17,-0.2 17,-0.2 95,-0.1 -0.838 18.5-121.8-106.1 144.2 60.9 25.4 45.1 7 7 L S E S+A 22 0A 65 15,-1.7 15,-2.3 -2,-0.4 2,-0.2 -0.989 78.8 13.3-147.2 133.8 63.7 26.6 47.4 8 8 L P - 0 0 47 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.665 64.6-153.6 -85.4-180.0 65.1 25.3 49.6 9 9 L A S S+ 0 0 69 1,-0.3 95,-3.7 94,-0.2 2,-0.4 0.845 85.3 20.4 -80.8 -35.9 64.3 21.6 49.2 10 10 L I E S+d 104 0B 67 93,-0.2 2,-0.3 76,-0.1 -1,-0.3 -0.999 73.2 172.8-135.3 133.3 64.9 20.9 52.9 11 11 L M E -d 105 0B 43 93,-2.9 95,-3.2 -2,-0.4 2,-0.4 -0.999 15.8-153.2-144.7 147.6 64.8 23.4 55.7 12 12 L S E +d 106 0B 51 -2,-0.3 2,-0.3 93,-0.2 95,-0.2 -0.903 17.7 167.3-118.7 146.5 65.0 23.3 59.5 13 13 L A E -d 107 0B 3 93,-1.6 95,-1.5 -2,-0.4 2,-0.1 -0.976 31.3-120.3-158.8 143.6 63.6 25.8 62.0 14 14 L S > - 0 0 46 -2,-0.3 3,-1.5 93,-0.2 65,-0.3 -0.467 49.1 -85.5 -80.9 158.3 63.0 26.0 65.7 15 15 L L T 3 S+ 0 0 94 93,-0.3 65,-0.2 1,-0.2 -1,-0.1 -0.293 115.1 29.6 -63.4 146.8 59.5 26.5 66.9 16 16 L G T 3 S+ 0 0 45 63,-2.8 -1,-0.2 1,-0.4 64,-0.1 0.230 93.5 126.7 87.7 -15.3 58.3 30.2 67.2 17 17 L E < - 0 0 74 -3,-1.5 62,-2.7 62,-0.2 2,-0.4 -0.391 65.8-116.3 -74.1 153.1 60.6 31.0 64.3 18 18 L R - 0 0 161 60,-0.2 2,-0.4 -3,-0.1 59,-0.2 -0.737 34.2-160.0 -89.0 139.7 59.3 32.8 61.2 19 19 L V E + B 0 76A 7 57,-3.6 57,-3.4 -2,-0.4 2,-0.4 -0.980 15.5 178.2-130.8 135.1 59.6 30.7 58.1 20 20 L T E + B 0 75A 68 -2,-0.4 2,-0.3 55,-0.3 55,-0.2 -0.997 1.8 177.6-134.4 130.5 59.5 31.6 54.4 21 21 L M E - B 0 74A 1 53,-2.5 53,-2.5 -2,-0.4 2,-0.2 -0.955 17.2-142.0-128.4 151.8 59.9 29.3 51.4 22 22 L T E -AB 7 73A 47 -15,-2.3 -15,-1.7 -2,-0.3 2,-0.3 -0.705 13.9-166.5-117.2 167.1 59.7 30.2 47.8 23 23 L a E -AB 6 72A 0 49,-2.3 49,-2.4 -2,-0.2 2,-0.4 -0.923 12.0-171.5-150.7 116.3 58.4 28.9 44.5 24 24 L T E -AB 5 71A 58 -19,-2.6 -19,-2.8 -2,-0.3 2,-0.3 -0.953 12.3-143.5-118.4 135.5 59.5 30.4 41.2 25 25 L A E -A 4 0A 10 45,-2.0 -21,-0.2 -2,-0.4 3,-0.1 -0.657 17.3-131.6 -93.8 149.2 58.0 29.6 37.8 26 26 L S E S+ 0 0 80 -23,-1.7 2,-0.3 -2,-0.3 -1,-0.1 0.683 98.0 15.9 -71.7 -16.5 60.0 29.4 34.5 27 27 L S E S- 0 0 46 -24,-0.2 -1,-0.2 42,-0.1 -25,-0.0 -0.981 101.9 -79.2-153.7 150.3 57.4 31.6 33.0 28 27AL S E - 0 0 69 -2,-0.3 2,-0.3 -3,-0.1 42,-0.2 -0.118 43.0-177.4 -58.4 146.4 54.6 33.8 34.4 29 28 L V E - B 0 69A 4 40,-2.2 40,-0.6 -4,-0.1 2,-0.2 -0.921 37.8 -87.2-137.8 162.6 51.2 32.6 35.7 30 29 L S > - 0 0 46 -2,-0.3 3,-2.4 1,-0.2 22,-0.1 -0.531 31.6-133.8 -70.5 133.8 48.1 34.1 37.1 31 30 L S G > S+ 0 0 50 1,-0.3 3,-0.7 -2,-0.2 -1,-0.2 0.722 108.9 63.5 -59.9 -18.0 48.4 34.5 40.9 32 31 L S G 3 S+ 0 0 48 1,-0.2 -1,-0.3 19,-0.1 19,-0.2 0.640 99.4 51.2 -79.7 -17.5 45.0 32.9 40.9 33 32 L N G < S+ 0 0 36 -3,-2.4 59,-2.6 18,-0.1 2,-0.5 0.080 88.8 94.4-107.3 18.1 46.3 29.7 39.4 34 33 L L E < +E 91 0B 0 -3,-0.7 18,-3.1 57,-0.2 2,-0.3 -0.961 52.2 173.6-115.3 122.5 49.1 29.1 41.9 35 34 L H E -E 90 0B 3 55,-2.9 55,-2.8 -2,-0.5 2,-0.4 -0.887 22.9-140.6-127.9 157.2 48.4 26.9 44.9 36 35 L W E -EF 89 49B 1 13,-3.3 12,-2.8 -2,-0.3 13,-1.0 -0.930 14.8-163.3-118.1 141.6 50.2 25.4 47.8 37 36 L Y E -EF 88 47B 23 51,-3.2 51,-2.7 -2,-0.4 2,-0.4 -0.939 7.6-148.3-124.0 144.3 49.7 21.9 49.2 38 37 L Q E -EF 87 46B 13 8,-3.3 8,-3.4 -2,-0.4 2,-0.4 -0.919 15.3-175.0-111.6 140.2 50.7 20.5 52.5 39 38 L Q E -E 86 0B 16 47,-2.3 47,-2.0 -2,-0.4 5,-0.1 -0.977 7.1-170.5-138.9 125.4 51.6 16.8 52.8 40 39 L K > - 0 0 70 -2,-0.4 3,-2.0 4,-0.3 45,-0.1 -0.843 48.0 -74.3-108.7 148.5 52.4 14.9 56.0 41 40 L P T 3 S+ 0 0 103 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.056 115.7 5.5 -44.9 131.2 53.7 11.3 55.9 42 41 L G T 3 S+ 0 0 94 1,-0.3 2,-0.2 -3,-0.0 -3,-0.0 0.153 112.2 99.5 81.5 -21.6 51.2 8.6 55.0 43 42 L S S < S- 0 0 63 -3,-2.0 -1,-0.3 1,-0.1 3,-0.1 -0.513 77.7-103.5 -95.9 165.2 48.5 11.2 54.3 44 43 L S - 0 0 12 -2,-0.2 -4,-0.3 1,-0.1 -1,-0.1 -0.527 48.1 -84.9 -86.2 153.0 47.3 12.7 51.1 45 44 L P - 0 0 0 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.263 47.1-151.1 -55.3 140.3 48.3 16.2 49.9 46 45 L K E -F 38 0B 53 -8,-3.4 -8,-3.3 -3,-0.1 2,-0.5 -0.944 18.8-113.6-121.5 138.5 46.1 18.9 51.3 47 46 L L E +F 37 0B 28 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.556 43.4 164.1 -69.0 118.5 45.2 22.3 49.8 48 47 L W E + 0 0 31 -12,-2.8 8,-3.0 -2,-0.5 2,-0.4 0.859 63.5 12.8-101.5 -61.0 46.8 24.8 52.1 49 48 L I E S-FG 36 55B 0 -13,-1.0 -13,-3.3 6,-0.2 -1,-0.4 -0.986 70.1-163.3-123.4 128.2 46.9 28.2 50.3 50 49 L Y E > + G 0 54B 42 4,-3.2 4,-2.1 -2,-0.4 3,-0.5 -0.881 67.9 12.2-114.3 146.7 44.9 28.8 47.1 51 50 L S T 4 S- 0 0 24 -2,-0.4 2,-2.1 1,-0.2 -1,-0.2 0.923 122.9 -70.7 57.8 47.2 45.3 31.5 44.5 52 51 L T T 4 S+ 0 0 4 -18,-3.1 -1,-0.2 -3,-0.3 21,-0.2 -0.157 129.1 25.1 70.5 -43.8 48.6 32.6 45.9 53 52 L S T 4 S+ 0 0 69 -2,-2.1 2,-0.5 -3,-0.5 12,-0.3 0.407 87.4 104.4-136.4 4.9 47.3 34.1 49.1 54 53 L N E < -G 50 0B 69 -4,-2.1 -4,-3.2 10,-0.1 2,-0.2 -0.813 62.0-133.6 -95.7 126.1 44.0 32.7 50.3 55 54 L L E -G 49 0B 55 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.535 22.6-126.5 -74.7 138.6 44.1 30.2 53.2 56 55 L A > - 0 0 11 -8,-3.0 3,-1.7 -2,-0.2 263,-0.1 -0.304 45.0 -66.8 -79.6 168.9 42.0 27.1 52.7 57 56 L S T 3 S+ 0 0 82 261,-1.6 -1,-0.2 260,-0.3 -10,-0.0 -0.330 122.8 14.9 -58.0 129.6 39.4 25.9 55.1 58 57 L G T 3 S+ 0 0 76 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.569 88.9 137.0 82.9 10.8 41.0 24.8 58.4 59 58 L V < - 0 0 18 -3,-1.7 -1,-0.3 -11,-0.1 -4,-0.1 -0.790 56.9-110.8 -94.9 130.2 44.4 26.4 57.8 60 59 L P > - 0 0 33 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.155 18.8-121.9 -57.5 149.5 46.0 28.3 60.8 61 60 L A T 3 S+ 0 0 99 1,-0.3 16,-0.1 15,-0.0 -2,-0.0 0.663 103.6 76.8 -67.2 -19.5 46.3 32.1 60.7 62 61 L R T 3 S+ 0 0 35 16,-0.1 15,-2.5 14,-0.1 2,-0.4 0.432 83.9 86.2 -71.8 2.6 50.1 31.9 61.2 63 62 L F E < +C 76 0A 5 -3,-1.3 2,-0.3 13,-0.2 13,-0.2 -0.855 52.3 161.1-106.3 140.3 50.3 31.0 57.5 64 63 L S E -C 75 0A 56 11,-2.3 11,-3.8 -2,-0.4 2,-0.3 -0.988 20.0-152.3-153.2 154.6 50.3 33.5 54.6 65 64 L G E -C 74 0A 7 -12,-0.3 2,-0.3 -2,-0.3 9,-0.2 -0.966 12.0-175.6-131.9 151.2 51.3 33.5 50.9 66 65 L S E +C 73 0A 74 7,-2.5 7,-2.2 -2,-0.3 2,-0.2 -0.946 24.7 72.5-142.0 161.0 52.6 36.2 48.6 67 66 L G E -C 72 0A 38 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.716 30.6-156.1 132.4 177.7 53.5 36.8 45.0 68 67 L S E > +C 71 0A 80 3,-1.6 3,-1.6 -2,-0.2 2,-0.6 -0.883 67.2 24.3 177.0 164.1 52.5 37.3 41.4 69 68 L G E 3 S-B 29 0A 26 -40,-0.6 -40,-2.2 -2,-0.3 -42,-0.1 -0.534 129.5 -26.0 71.7-112.6 54.1 36.8 38.0 70 69 L T E 3 S+ 0 0 63 -2,-0.6 -45,-2.0 -42,-0.2 2,-0.5 0.341 121.8 76.6-119.2 2.5 56.9 34.2 38.4 71 70 L S E < +BC 24 68A 67 -3,-1.6 -3,-1.6 -47,-0.2 2,-0.3 -0.962 50.0 160.1-124.8 124.2 57.7 34.6 42.1 72 71 L Y E -BC 23 67A 2 -49,-2.4 -49,-2.3 -2,-0.5 2,-0.3 -0.887 11.7-171.7-133.7 162.3 55.7 33.2 45.0 73 72 L S E -BC 22 66A 24 -7,-2.2 -7,-2.5 -2,-0.3 2,-0.4 -0.993 15.5-146.2-156.1 152.9 56.3 32.5 48.6 74 73 L L E -BC 21 65A 0 -53,-2.5 -53,-2.5 -2,-0.3 2,-0.4 -0.983 22.3-165.0-122.0 133.9 54.7 30.8 51.6 75 74 L T E -BC 20 64A 11 -11,-3.8 -11,-2.3 -2,-0.4 2,-0.5 -0.946 17.0-162.6-126.8 144.7 55.3 32.2 55.1 76 75 L I E -BC 19 63A 0 -57,-3.4 -57,-3.6 -2,-0.4 3,-0.3 -0.983 7.6-161.8-122.2 114.5 54.8 30.9 58.6 77 76 L S S S+ 0 0 53 -15,-2.5 2,-0.5 -2,-0.5 -1,-0.2 0.958 83.7 13.6 -60.4 -54.3 55.0 33.7 61.2 78 77 L S S S- 0 0 52 -16,-0.2 -1,-0.3 -60,-0.1 -60,-0.2 -0.940 83.7-136.6-130.0 111.1 55.5 31.4 64.2 79 78 L M - 0 0 1 -62,-2.7 -63,-2.8 -2,-0.5 2,-0.3 -0.416 21.8-173.6 -70.3 134.1 56.4 27.8 63.5 80 79 L E > - 0 0 89 -65,-0.2 3,-1.9 -2,-0.2 4,-0.4 -0.793 38.7-104.3-120.9 164.7 54.8 25.0 65.5 81 80 L A G > S+ 0 0 63 1,-0.3 3,-1.8 -2,-0.3 -1,-0.1 0.900 118.7 58.4 -55.2 -45.2 55.4 21.3 65.7 82 81 L E G 3 S+ 0 0 114 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.503 93.7 70.6 -65.7 -2.7 52.4 20.4 63.6 83 82 L D G < + 0 0 2 -3,-1.9 -1,-0.3 2,-0.1 2,-0.2 0.715 68.4 107.8 -86.1 -21.6 53.8 22.6 60.8 84 83 L A < + 0 0 24 -3,-1.8 2,-0.3 -4,-0.4 22,-0.2 -0.402 51.9 100.0 -59.6 119.7 56.6 20.2 60.0 85 84 L A E S- H 0 105B 8 20,-0.7 20,-3.4 -2,-0.2 2,-0.4 -0.906 76.0 -75.8-174.9-165.5 55.6 18.7 56.7 86 85 L T E -EH 39 104B 29 -47,-2.0 -47,-2.3 -2,-0.3 2,-0.5 -0.966 38.9-152.6-118.3 134.9 56.4 19.0 53.0 87 86 L Y E -EH 38 103B 0 16,-2.3 16,-1.9 -2,-0.4 2,-0.4 -0.940 8.7-168.1-114.5 128.8 55.0 21.9 51.0 88 87 L Y E -E 37 0B 15 -51,-2.7 -51,-3.2 -2,-0.5 2,-0.3 -0.935 9.0-153.1-115.3 132.6 54.2 21.8 47.3 89 88 L a E -E 36 0B 0 -2,-0.4 11,-2.3 -53,-0.2 2,-0.3 -0.766 18.8-168.9 -97.9 152.9 53.4 24.7 45.0 90 89 L H E -EI 35 99B 14 -55,-2.8 -55,-2.9 -2,-0.3 2,-0.5 -0.998 15.9-149.0-144.3 140.7 51.3 23.9 42.0 91 90 L Q E +EI 34 98B 0 7,-1.6 7,-0.8 -2,-0.3 -57,-0.2 -0.969 13.2 178.1-113.8 124.1 50.4 25.8 38.9 92 91 L Y + 0 0 34 -59,-2.6 3,-0.1 -2,-0.5 -58,-0.1 -0.282 60.1 99.0-113.1 40.7 47.0 25.1 37.3 93 92 L H S S+ 0 0 80 1,-0.3 2,-0.4 -60,-0.2 -1,-0.1 0.898 87.9 8.6 -94.3 -52.6 47.7 27.7 34.7 94 93 L R S S- 0 0 113 2,-0.2 -92,-0.5 -3,-0.1 -1,-0.3 -0.965 93.4 -85.1-139.4 120.8 48.9 25.9 31.6 95 94 L S S S+ 0 0 37 -2,-0.4 2,-0.1 -3,-0.1 -3,-0.1 -0.284 106.2 60.5 -67.1 150.5 48.9 22.2 31.1 96 95 L P S S- 0 0 23 0, 0.0 -94,-0.4 0, 0.0 2,-0.2 0.410 92.7-137.8 -68.7 134.3 50.6 20.0 31.7 97 96 L Y - 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